EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H17N5O2 |
| Net Charge | 0 |
| Average Mass | 323.356 |
| Monoisotopic Mass | 323.13822 |
| SMILES | Nc1nc(N2CCN(C(=O)c3ccco3)CC2)nc2ccccc12 |
| InChI | InChI=1S/C17H17N5O2/c18-15-12-4-1-2-5-13(12)19-17(20-15)22-9-7-21(8-10-22)16(23)14-6-3-11-24-14/h1-6,11H,7-10H2,(H2,18,19,20) |
| InChIKey | DECAUZVEBBDOOT-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| [4-(4-amino-2-quinazolinyl)-1-piperazinyl]-(2-furanyl)methanone (CHEBI:103994) is a N-arylpiperazine (CHEBI:46848) |
| Manual Xrefs | Databases |
|---|---|
| LSM-15348 | LINCS |